3,5-dimethyl-1-[2-(3-nitro-4-phenylmethoxy-phenyl)ethyl]piperidine

Systemtic Name: 3,5-dimethyl-1-[2-(3-nitro-4-phenylmethoxy-phenyl)ethyl]piperidine Openeye Name: 1-[2-(4-benzyloxy-3-nitro-phenyl)ethyl]-3,5-dimethyl-piperidine CAS Name: 3,5-dimethyl-1-[2-(3-nitro-4-phenylmethoxyphenyl)ethyl]piperidine IUPAC Name: 3,5-dimethyl-1-[2-(3-nitro-4-phenylmethoxyphenyl)ethyl]piperidine Traditional Name: 1-[2-(4-benzoxy-3-nitro-phenyl)ethyl]-3,5-dimethyl-piperidine Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)CCC2=CC(=C(C=C2)OCC3=CC=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)CCC2=CC(=C(C=C2)OCC3=CC=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C22H28N2O3/c1-17-12-18(2)15-23(14-17)11-10-19-8-9-22(21(13-19)24(25)26)27-16-20-6-4-3-5-7-20/h3-9,13,17-18H,10-12,14-16H2,1-2H3